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/nfs/dbraw/zinc/02/57/05/538025705.db2.gz DPMDBBOHZSOJTP-UHFFFAOYSA-N 1 2 155.201 -0.166 20 0 ABADLO C[N@H+](CCO)Cc1cnc[nH]1 159163391 538030778 /nfs/dbraw/zinc/03/07/78/538030778.db2.gz CNVGWWUDDPEZCK-UHFFFAOYSA-N 1 2 155.201 -0.166 20 0 ABADLO C[N@@H+](CCO)Cc1cnc[nH]1 159163391 538030783 /nfs/dbraw/zinc/03/07/83/538030783.db2.gz CNVGWWUDDPEZCK-UHFFFAOYSA-N 1 2 155.201 -0.166 20 0 ABADLO CC[N@@H+](CCO)Cc1cn(C)nn1 230351102 538208085 /nfs/dbraw/zinc/20/80/85/538208085.db2.gz KXOHLKNEWYENQC-UHFFFAOYSA-N 1 2 184.243 -0.371 20 0 ABADLO CC[N@H+](CCO)Cc1cn(C)nn1 230351102 538208078 /nfs/dbraw/zinc/20/80/78/538208078.db2.gz KXOHLKNEWYENQC-UHFFFAOYSA-N 1 2 184.243 -0.371 20 0 ABADLO Cn1cc(C[N@H+](CCO)C2CC2)nn1 230350892 538209088 /nfs/dbraw/zinc/20/90/88/538209088.db2.gz WIXFRUCHCIPHMK-UHFFFAOYSA-N 1 2 196.254 -0.228 20 0 ABADLO Cn1cc(C[N@@H+](CCO)C2CC2)nn1 230350892 538209093 /nfs/dbraw/zinc/20/90/93/538209093.db2.gz WIXFRUCHCIPHMK-UHFFFAOYSA-N 1 2 196.254 -0.228 20 0 ABADLO 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234019510 538235885 /nfs/dbraw/zinc/23/58/85/538235885.db2.gz ZFRYQEHARVDBCR-SSDOTTSWSA-N 1 2 199.258 -0.275 20 0 ABADLO COCC(C)(C)[NH2+]Cc1nnn(C)n1 234610317 538237367 /nfs/dbraw/zinc/23/73/67/538237367.db2.gz QZJCEDPSKFAICL-UHFFFAOYSA-N 1 2 199.258 -0.275 20 0 ABADLO COC[C@H](C)[NH2+]Cc1nnn(C)n1 234697248 538237496 /nfs/dbraw/zinc/23/74/96/538237496.db2.gz UNLCUXBQGSGKBZ-LURJTMIESA-N 1 2 185.231 -0.665 20 0 ABADLO C[C@H]1OCC[C@@H]1[NH2+]Cc1nnn(C)n1 235591497 538245359 /nfs/dbraw/zinc/24/53/59/538245359.db2.gz CAEMFUBDKAGLGJ-RQJHMYQMSA-N 1 2 197.242 -0.523 20 0 ABADLO Cn1nnc(C[N@H+](C)C(C)(C)CO)n1 234319760 538238854 /nfs/dbraw/zinc/23/88/54/538238854.db2.gz VLNSGCWSUNYQKX-UHFFFAOYSA-N 1 2 199.258 -0.587 20 0 ABADLO Cn1nnc(C[N@@H+](C)C(C)(C)CO)n1 234319760 538238865 /nfs/dbraw/zinc/23/88/65/538238865.db2.gz VLNSGCWSUNYQKX-UHFFFAOYSA-N 1 2 199.258 -0.587 20 0 ABADLO Cn1nnc(C[N@H+](C)CC(C)(C)O)n1 234319999 538239807 /nfs/dbraw/zinc/23/98/07/538239807.db2.gz QABMBQMWJJMFNO-UHFFFAOYSA-N 1 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